2-Naphthaldehyde

2-Naphthaldehyde

SCHEMBL434215

CCOC(C)OCC.O=Cc1ccc2ccccc2c1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.47
NQO2 P16083 2/20 0.41
ALDH1A1 P00352 3/20 0.40
RELA Q04206 1/20 0.40
PTGS1 P23219 1/20 0.39
ALDH1A3 P47895 1/20 0.39
GAA P10253 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CNR2 P34972 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA7 P36544 1/20 0.38
TYR P14679 1/20 0.38
TTR P02766 1/20 0.38
LMNA P02545 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
GLA P06280 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3858045 0.83 ALDH1A3 (0.45) RAB9AALDH1A1ALDH1A3LMNAMAPT
Benzaldehyde SCHEMBL367504 0.80 ALDH1A1 (0.54) ALDH1A1RELAALDH1A3L3MBTL1TYR
SCHEMBL372348 0.80 KDM4E (0.48) RAB9AALDH1A1GAAL3MBTL1LMNA
2-Naphthaldehyde SCHEMBL28110154 0.79 RELA (0.58) RAB9ANQO2ALDH1A1RELAPTGS1
2-Naphthaldehyde SCHEMBL30229844 0.79 RELA (0.58) RAB9ANQO2ALDH1A1RELAPTGS1
2-Naphthaldehyde SCHEMBL51340 0.79 RELA (0.58) RAB9ANQO2ALDH1A1RELAPTGS1
2-Naphthaldehyde SCHEMBL27347080 0.79 RELA (0.58) RAB9ANQO2ALDH1A1RELAPTGS1
SCHEMBL27914859 0.79 NQO2 (0.45) NQO2ALDH1A1RELAPTGS1GAA
Ethylene SCHEMBL6226363 0.78 LMNA (0.48) ALDH1A1ALDH1A3TYRLMNAMAPT
SCHEMBL9632142 0.78 MAOA (0.49) RAB9AALDH1A1PTGS1TDP1TTR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317490-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A., (ES) 2021-10-14 US disclosed
EP-3640236-A1 A METHOD OF PRODUCING INGENOL-3-ANGELATE LEO LABORATORIES LIMITED (IE) 2020-04-22 EP disclosed
CN-110650954-A Anticancer compounds 法马马有限公司 2020-01-03 CN disclosed
EP-2595948-B1 A METHOD OF PRODUCING INGENOL-3-ANGELATE LEO LABORATORIES LTD (IE) 2019-09-04 EP disclosed
WO-2018167270-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2018-09-20 WO disclosed
EP-3004036-B1 METHODS OF SYNTHESIS OF INGENOL AND INTERMEDIATES THEREOF LEO LABORATORIES LTD (IE) 2017-11-22 EP disclosed
EP-2864290-B1 3-O-HETEROARYL-INGENOL LEO LABORATORIES LTD (IE) 2017-06-14 EP disclosed
US-9676698-B2 Method of producing ingenol-3-angelate LEO LABORATORIES LIMITED (IE) 2017-06-13 US disclosed
US-20160280627-A1 METHOD OF PRODUCING INGENOL-3-ANGELATE LEO LABORATORIES LIMITED (IE) 2016-09-29 US disclosed
US-9422309-B2 3-O-heteroaryl-ingenol LEO LABORATORIES LIMITED (IE) 2016-08-23 US disclosed
EP-2864290-A2 3-O-HETEROARYL-INGENOL Leo Laboratories Limited (IE) 2015-04-29 EP disclosed
CN-104411685-A 3-o-heteroaryl-ingenol LEO LAB LTD 2015-03-11 CN disclosed
WO-2014191457-A1 METHODS OF SYNTHESIS OF INGENOL AND INTERMEDIATES THEREOF LEO LABORATORIES LIMITED (IE) 2014-12-04 WO disclosed
US-8901356-B2 Method of producing ingenol-3-angelate LEO LABORATORIES LIMITED (IE) 2014-12-02 US disclosed
WO-2014108526-A1 SYNTHETIC PROCESS FOR THE MANUFACTURE OF PIPECOLIDEPSIN COMPOUNDS PHARMA MAR, S.A. (ES) 2014-07-17 WO disclosed
WO-2014001215-A2 3-O-HETEROARYL-INGENOL LEO LABORATORIES LIMITED (IE) 2014-01-03 WO disclosed
US-20130177952-A1 METHOD OF PRODUCING INGENOL-3-ANGELATE Hogberg, Thomas (DK) 2013-07-11 US disclosed
EP-2595948-A1 A METHOD OF PRODUCING INGENOL-3-ANGELATE LEO LABORATORIES LIMITED (IE) 2013-05-29 EP disclosed
CN-103119016-A Method for preparing ingenol-3-angelate LEO PHARMA AS 2013-05-22 CN disclosed
WO-2012010172-A1 A METHOD OF PRODUCING INGENOL-3-ANGELATE LEO PHARMA A/S (DK) 2012-01-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210317490-A1 ANTICANCER COMPOUNDS SLC75A1, SLC15A1, LCT RAB9A 1871/4885NQO2 1188/4885ALDH1A1 947/4885
US-20130177952-A1 METHOD OF PRODUCING INGENOL-3-ANGELATE PRKAG3, AMPD3, ERG28 RAB9A 2498/4885NQO2 514/4885ALDH1A1 1005/4885
US-20160280627-A1 METHOD OF PRODUCING INGENOL-3-ANGELATE PRKAG3, AMPD3, ERG28 RAB9A 2498/4885NQO2 514/4885ALDH1A1 1005/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.